1-piperidin-1-ium-4-yl-5-(trifluoromethyl)benzotriazole

Systemtic Name: 1-piperidin-1-ium-4-yl-5-(trifluoromethyl)benzotriazole Openeye Name: 1-piperidin-1-ium-4-yl-5-(trifluoromethyl)benzotriazole CAS Name: 1-(4-piperidin-1-iumyl)-5-(trifluoromethyl)benzotriazole IUPAC Name: 1-piperidin-1-ium-4-yl-5-(trifluoromethyl)benzotriazole Traditional Name: 1-piperidin-1-ium-4-yl-5-(trifluoromethyl)benzotriazole Formula: C12H14F3N4+ MolecularWeight: 271.26157

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1N2C3=C(C=C(C=C3)C(F)(F)F)N=N2

Isomeric SMILES

C1C[NH2+]CCC1N2C3=C(C=C(C=C3)C(F)(F)F)N=N2

InChI

InChI=1S/C12H13F3N4/c13-12(14,15)8-1-2-11-10(7-8)17-18-19(11)9-3-5-16-6-4-9/h1-2,7,9,16H,3-6H2/p+1